SCHEMBL7280593

SCHEMBL7280593

O=C1CCC(c2ccc(OCCCl)cc2)=NN1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.75
LMNA P02545 2/20 0.75
NPY1R P25929 1/20 0.75
NPY2R P49146 1/20 0.75
KMT2A Q03164 1/20 0.70
HRH3 Q9Y5N1 5/20 0.65
SMN1; SMN2 Q16637 1/20 0.54
PDE3B Q13370 9/20 0.48
PDE3A Q14432 9/20 0.48
PDE4A P27815 2/20 0.48
PDE4B Q07343 2/20 0.48
PDE4C Q08493 2/20 0.48
PDE4D Q08499 2/20 0.48
KCNH2 Q12809 1/20 0.48
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
TSHR P16473 1/20 0.45
MAPK1 P28482 1/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1373314 0.94 LMNA (0.80) MAPTLMNANPY1RNPY2RKMT2A
SCHEMBL6795295 0.86 MAPT (0.75) MAPTLMNANPY1RNPY2RKMT2A
SCHEMBL10967326 0.86 LMNA (1.00) MAPTLMNANPY1RNPY2RKMT2A
SCHEMBL10970095 0.86 MAPT (1.00) MAPTLMNANPY1RNPY2RKMT2A
SCHEMBL10370953 0.84 MAPT (0.78) MAPTLMNANPY1RNPY2RKMT2A
SCHEMBL7306239 0.84 LMNA (0.78) MAPTLMNANPY1RNPY2RKMT2A
SCHEMBL8116038 0.83 LMNA (0.76) MAPTLMNANPY1RNPY2RKMT2A
SCHEMBL10968693 0.82 MAPT (0.79) MAPTLMNANPY1RNPY2RKMT2A
SCHEMBL10963833 0.82 MAPT (1.00) MAPTLMNANPY1RNPY2RKMT2A
SCHEMBL9815953 0.82 LMNA (0.92) MAPTLMNANPY1RNPY2RKMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4734415-A CARDIOTONIC, HYPOTENSIVE WARNER-LAMBERT COMPANY (US) 1988-03-29 US disclosed
EP-0075436-A1 Substituted 4,5-dihydro-6-(substituted)-phenyl-3(2H)-pyridazinones and 6-(substituted)phenyl-3(2H)-pyridazinones WARNER-LAMBERT COMPANY (US) 1983-03-30 EP disclosed